7-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-methyl-2-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-methyl-2-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSC3=NNC(=N3)C4=CC=CC=C4)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSC3=NNC(=N3)C4=CC=CC=C4)C=C1

InChI

InChI=1S/C18H15N5OS/c1-12-7-8-15-19-14(9-16(24)23(15)10-12)11-25-18-20-17(21-22-18)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,21,22)